canSAR1773718
FEATURES
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NAMES
    SMILES
    O=C(O)CO/N=C/c1nc2ccccc2n1[C@@H]1C[C@@H]2CCC[C@H](C1)N2[C@@H]1C[C@H]2CCC[C@H](C2)C1
    InChI
    InChI=1S/C27H36N4O3/c32-27(33)17-34-28-16-26-29-24-9-1-2-10-25(24)31(26)23-14-20-7-4-8-21(15-23)30(20)22-12-18-5-3-6-19(11-18)13-22/h1-2,9-10,16,18-23H,3-8,11-15,17H2,(H,32,33)/b28-16+/t18-,19+,20-,21+,22+,23+
    MOLECULAR FORMULA
    C27H36N4O3
    CROSS REFERENCES
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    canSAR1773718
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight464.28
    AlogP5.00
    HBond donors1
    HBond acceptors7
    Atoms70
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1773718.